200,000+ products from a single source!
sales@angenechem.com
99209-26-4 | Benzaldehyde, 4-(1-octynyl)-
CAS No: 99209-26-4 Catalog No: AG0066A4 MDL No:
Product Description
Catalog Number:
AG0066A4
Chemical Name:
Benzaldehyde, 4-(1-octynyl)-
CAS Number:
99209-26-4
Molecular Formula:
C15H18O
Molecular Weight:
214.3028
IUPAC Name:
4-oct-1-ynylbenzaldehyde
InChI:
InChI=1S/C15H18O/c1-2-3-4-5-6-7-8-14-9-11-15(13-16)12-10-14/h9-13H,2-6H2,1H3
InChI Key:
VHCWNODIVKXJOG-UHFFFAOYSA-N
SMILES:
CCCCCCC#Cc1ccc(cc1)C=O
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.136g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.308g/mol
Monoisotopic Mass:
214.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.